Geometry & MOs

Info

ID:	346593
PubChem CID:	127271097
Reduced:	N3O4C17H27 (1)
Stoich.:	A3B4C17D27 (1)
Weight, g/mol:	363.190654
ΔH_f, kcal/mol:	-208.67
Dipole, Da:	7.01
IP(EA), eV:	-9.61(-0.19)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(1,3-dimethyl-2,6-dioxopurin-7-yl)-N-[1-(oxolan-2-yl)propan-2-yl]propanamide

Drug info:

PubChemData

Smile

CC(CC1CCCO1)NC(=O)CN2C(=O)C3(CCCCC3)NC2=O

DOS

IR

Vibrations